13-ethyl-4-oxo-N-propan-2-yl-3,9,13-triazadispiro[4.0.56.35]tetradecane-9-carboxamide

C17H30N4O2 — CID 134079476

IUPAC13-ethyl-4-oxo-N-propan-2-yl-3,9,13-triazadispiro[4.0.56.35]tetradecane-9-carboxamide
SMILESCCN1CC2(CCN(C(=O)NC(C)C)CC2)C2(CCNC2=O)C1
InChIInChI=1S/C17H30N4O2/c1-4-20-11-16(17(12-20)5-8-18-14(17)22)6-9-21(10-7-16)15(23)19-13(2)3/h13H,4-12H2,1-3H3,(H,18,22)(H,19,23)
InChIKeyUOHZRXXOGDYZII-UHFFFAOYSA-N
MW322.45 g/mol
LogP1.03
Rot. Bonds2

About 13-ethyl-4-oxo-N-propan-2-yl-3,9,13-triazadispiro[4.0.56.35]tetradecane-9-carboxamide

13-ethyl-4-oxo-N-propan-2-yl-3,9,13-triazadispiro[4.0.56.35]tetradecane-9-carboxamide (PubChem CID 134079476) has the molecular formula C17H30N4O2 and a molecular weight of 322.45 g/mol. Its IUPAC name is 13-ethyl-4-oxo-N-propan-2-yl-3,9,13-triazadispiro[4.0.56.35]tetradecane-9-carboxamide.

Molecular Properties

Compound Name13-ethyl-4-oxo-N-propan-2-yl-3,9,13-triazadispiro[4.0.56.35]tetradecane-9-carboxamide
PubChem CID134079476
Molecular FormulaC17H30N4O2
Molecular Weight322.45 g/mol
Exact Mass322.24
IUPAC Name13-ethyl-4-oxo-N-propan-2-yl-3,9,13-triazadispiro[4.0.56.35]tetradecane-9-carboxamide
SMILESCCN1CC2(CCN(C(=O)NC(C)C)CC2)C2(CCNC2=O)C1
InChIInChI=1S/C17H30N4O2/c1-4-20-11-16(17(12-20)5-8-18-14(17)22)6-9-21(10-7-16)15(23)19-13(2)3/h13H,4-12H2,1-3H3,(H,18,22)(H,19,23)
InChIKeyUOHZRXXOGDYZII-UHFFFAOYSA-N
XLogP1.03
TPSA64.68 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.45
LogP ≤ 51.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-Isobutyl-8-[(2-oxoimidazolidin-4-yl)carbonyl]-2,8-diazaspiro[4.5]decan-3-one
CID 72917943
(3aS,6aR)-N,N-dimethyl-1'-(3-methylbutanoyl)-1-oxospiro[3a,4,6,6a-tetrahydro-2H-pyrrolo[3,4-c]pyrrole-3,4'-piperidine]-5-carboxamide
CID 97439099
2-oxo-N-propan-2-yl-1-(2-pyrrolidin-1-ylethyl)-1,8-diazaspiro[4.5]decane-8-carboxamide
CID 97493805
(3aS,6aR)-N,N-dimethyl-1'-(2-methylpropanoyl)-1-oxospiro[3a,4,6,6a-tetrahydro-2H-pyrrolo[3,4-c]pyrrole-3,4'-piperidine]-5-carboxamide
CID 97522186
(3aS,6aR)-5-N,5-N-dimethyl-1-oxo-1-N'-propan-2-ylspiro[3a,4,6,6a-tetrahydro-2H-pyrrolo[3,4-c]pyrrole-3,4'-piperidine]-1',5-dicarboxamide
CID 97522188
(3aS,6aR)-5-N,5-N,2-trimethyl-1-oxo-1-N'-propan-2-ylspiro[3a,4,6,6a-tetrahydropyrrolo[3,4-c]pyrrole-3,4'-piperidine]-1',5-dicarboxamide
CID 97522263
(3aS,6aR)-5-ethyl-2-(2-methylpropyl)-6-oxo-N-propan-2-ylspiro[1,3,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-4,4'-piperidine]-1'-carboxamide
CID 97522267
9,13-Diacetyl-3,9,13-triazadispiro[4.0.56.35]tetradecan-4-one
CID 118738721
13-acetyl-3-ethyl-N,N-dimethyl-4-oxo-3,9,13-triazadispiro[4.0.56.35]tetradecane-9-carboxamide
CID 118738723
N-cyclopropyl-1-oxo-2,9-diazaspiro[4.5]decane-9-carboxamide
CID 118738734
9-(cyclopropylmethyl)-3-ethyl-N,N-dimethyl-4-oxo-3,9,13-triazadispiro[4.0.56.35]tetradecane-13-carboxamide
CID 118742190
9-Acetyl-13-(2-methylpropyl)-3,9,13-triazadispiro[4.0.56.35]tetradecan-4-one
CID 118742203

Frequently Asked Questions

What is the IUPAC name of 13-ethyl-4-oxo-N-propan-2-yl-3,9,13-triazadispiro[4.0.56.35]tetradecane-9-carboxamide?
The IUPAC name of 13-ethyl-4-oxo-N-propan-2-yl-3,9,13-triazadispiro[4.0.56.35]tetradecane-9-carboxamide (CID 134079476) is 13-ethyl-4-oxo-N-propan-2-yl-3,9,13-triazadispiro[4.0.56.35]tetradecane-9-carboxamide.
What is the SMILES notation for 13-ethyl-4-oxo-N-propan-2-yl-3,9,13-triazadispiro[4.0.56.35]tetradecane-9-carboxamide?
The canonical SMILES for 13-ethyl-4-oxo-N-propan-2-yl-3,9,13-triazadispiro[4.0.56.35]tetradecane-9-carboxamide is CCN1CC2(CCN(C(=O)NC(C)C)CC2)C2(CCNC2=O)C1.
What is the InChIKey of 13-ethyl-4-oxo-N-propan-2-yl-3,9,13-triazadispiro[4.0.56.35]tetradecane-9-carboxamide?
The InChIKey is UOHZRXXOGDYZII-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H30N4O2/c1-4-20-11-16(17(12-20)5-8-18-14(17)22)6-9-21(10-7-16)15(23)19-13(2)3/h13H,4-12H2,1-3H3,(H,18,22)(H,19,23).
What are the key properties of 13-ethyl-4-oxo-N-propan-2-yl-3,9,13-triazadispiro[4.0.56.35]tetradecane-9-carboxamide?
13-ethyl-4-oxo-N-propan-2-yl-3,9,13-triazadispiro[4.0.56.35]tetradecane-9-carboxamide has a molecular weight of 322.45 g/mol, XLogP of 1.03, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 13-ethyl-4-oxo-N-propan-2-yl-3,9,13-triazadispiro[4.0.56.35]tetradecane-9-carboxamide is sourced from PubChem (CID 134079476), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).